propyl 2-[1-(3-bromanyl-4-phenethyloxy-phenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: propyl 2-[1-(3-bromanyl-4-phenethyloxy-phenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: propyl 2-[1-(3-bromo-4-phenethyloxy-benzoyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(3-bromo-4-phenethyloxyphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid propyl ester IUPAC Name: propyl 2-[1-(3-bromo-4-phenethyloxybenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(3-bromo-4-phenethyloxy-benzoyl)-3-keto-piperazin-2-yl]acetic acid propyl ester Formula: C24H27BrN2O5 MolecularWeight: 503.38558

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

Isomeric SMILES

CCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

InChI

InChI=1S/C24H27BrN2O5/c1-2-13-32-22(28)16-20-23(29)26-11-12-27(20)24(30)18-8-9-21(19(25)15-18)31-14-10-17-6-4-3-5-7-17/h3-9,15,20H,2,10-14,16H2,1H3,(H,26,29)